Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.37 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.35 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.34 |
| ▸ | ATR | Q13535 | 1/20 | 0.33 |
| ▸ | CKS1B | P61024 | 1/20 | 0.33 |
| ▸ | SKP1 | P63208 | 1/20 | 0.33 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL4304300 | 0.82 | F10 (0.39) | ROCK2ROCK1HCRTR2 | |
| SCHEMBL1018735 | 0.82 | ABL1 (0.46) | HCRTR2 | |
| SCHEMBL1018117 | 0.81 | CNR2 (0.39) | PDE10AHCRTR2CKS1BSKP1SKP2 | |
| SCHEMBL4304296 | 0.79 | ROCK2 (0.44) | ROCK2ROCK1CKS1BSKP1SKP2 | |
| SCHEMBL12082948 | 0.78 | CKS1B (0.54) | ROCK2ROCK1IRAK1CKS1BSKP1 | |
| SCHEMBL27809364 | 0.77 | AAK1 (0.44) | PDE10AHCRTR2 | |
| SCHEMBL785865 | 0.77 | ITGB3 (0.44) | — | |
| SCHEMBL1018019 | 0.76 | CNR1 (0.35) | ROCK2ROCK1HCRTR2CKS1BSKP1 | |
| SCHEMBL1021392 | 0.74 | ENPP1 (0.33) | CKS1BSKP1SKP2 | |
| SCHEMBL15990720 | 0.72 | CA12 (0.43) | ATR |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2271631-A2 | INHIBITORS OF PROTEIN KINASES | Portola Pharmaceuticals, Inc. (US) | 2011-01-12 | — | — | EP | disclosed |
| WO-2009131687-A2 | INHIBITORS OF PROTEIN KINASES | PORTOLA PHARMACEUTICALS, INC. (US) | 2009-10-29 | — | — | WO | disclosed |